(3-chloranyl-1-benzothiophen-2-yl)-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]methanone Openeye Name: (3-chlorobenzothiophen-2-yl)-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazin-1-yl]methanone CAS Name: (3-chloro-1-benzothiophen-2-yl)-[4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-chloro-1-benzothiophen-2-yl)-[4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]piperazin-1-yl]methanone Traditional Name: (3-chlorobenzothiophen-2-yl)-[4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]piperazino]methanone Formula: C20H23ClN4OS MolecularWeight: 402.94082

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H23ClN4OS/c1-3-25-13-15(14(2)22-25)12-23-8-10-24(11-9-23)20(26)19-18(21)16-6-4-5-7-17(16)27-19/h4-7,13H,3,8-12H2,1-2H3